SCHEMBL840929

SCHEMBL840929

CCCCCN(CC)CCC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 14/20 0.47
DNM1 Q05193 3/20 0.37
PLA2G1B P04054 1/20 0.36
PLA2G2A P14555 1/20 0.36
KDM5A P29375 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
SIGMAR1 Q99720 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL841874 0.98 KCNH2 (0.50) KCNH2DNM1PLA2G1BPLA2G2AKDM5A
SCHEMBL842083 0.93 KCNH2 (0.42) KCNH2PLA2G1BPLA2G2AKDM5AKDM4C
SCHEMBL13609859 0.86 KCNH2 (0.41) KCNH2DNM1PLA2G1BPLA2G2AKDM5A
SCHEMBL841870 0.85 TSHR (0.33) KCNH2
SCHEMBL25018206 0.83 CA12 (0.34) KCNH2DNM1KDM5AKDM4C
SCHEMBL841865 0.83 CA12 (0.34) KCNH2DNM1KDM5AKDM4C
SCHEMBL866725 0.83 KCNH2 (0.31) KCNH2
SCHEMBL516406 0.83 KCNH2 (0.54) KCNH2DNM1PLA2G1BPLA2G2AKDM5A
SCHEMBL15383389 0.82 SIGMAR1 (0.38) KCNH2KDM5AKDM4CSIGMAR1
SCHEMBL26455606 0.81 SIGMAR1 (0.40) KCNH2KDM5AKDM4CSIGMAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150258068-A1 COMBINATION THERAPIES MEI PHARMA, INC. 2015-09-17 US disclosed
US-8143282-B2 Heterocyclic compounds S*BIO PTE LTD. (SG) 2012-03-27 US disclosed
US-20100098691-A1 COMBINATION OF BENZIMIDAZOLE ANTI-CANCER AGENT AND A SECOND ANTI-CANCER AGENT S'BIO PTE LTD (SG) 2010-04-22 US disclosed
US-20090048300-A1 Heterocyclic Compounds S*BIO PTE LTD. (SG) 2009-02-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090048300-A1 Heterocyclic Compounds HDAC1, HDAC3, HDAC11 KCNH2 3688/4885DNM1 2396/4885PLA2G1B 4511/4885
US-20100098691-A1 COMBINATION OF BENZIMIDAZOLE ANTI-CANCER AGENT AND A SECOND ANTI-CANCER AGENT PAICS, HDAC5, HDAC4 KCNH2 3386/4885DNM1 3264/4885PLA2G1B 2035/4885
US-20150258068-A1 COMBINATION THERAPIES HDAC1, HDAC8, HDAC5 KCNH2 4347/4885DNM1 2751/4885PLA2G1B 4546/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.